COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK963882
Chemical Name: 4-{[(E)-(4-nitrophenyl)methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccc(cc1)[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 317.25
Empirical Formula: C10H6F3N5O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.576
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 127
Number of rings: 2

     

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